Vitas-M small molecule compound
methyl 3-{[2-(2,3-dimethylcyclohexyl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}-3-(2-ethylphenyl)propanoate
Catalog ID
STK079657
SMILES COC(=O)CC(c1ccccc1CC)NC1N(C2CCCC(C2C)C)C(=O)c2c1cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H36N2O3 MW 448.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O3/c1-5-20-12-6-7-13-21(20)24(17-26(31)33-4)29-27-22-14-8-9-15-23(22)28(32)30(27)25-16-10-11-18(2)19(25)3/h6-9,12-15,18-19,24-25,27,29H,5,10-11,16-17H2,1-4H3InChIKey
VIRAINOWLHFODO-UHFFFAOYSA-NSynonyms
CCC1=CC=CC=C1C(CC(=O)OC)NC2C3=CC=CC=C3C(=O)N2C4CCCC(C4C)C
COC(=O)CC(c1ccccc1CC)NC1N(C2CCCC(C2C)C)C(=O)c2c1cccc2
InChI=1SC28H36N2O3c152012671321(20)24(1726(31)334)29272214891523(22)28(32)30(27)2516101118(2)19(25)3h691215181924252729H510111617H214H3
methyl3((2(23dimethylcyclohexyl)3oxo1Hisoindol1yl)amino)3(2ethylphenyl)propanoate
METHYL3((2(23DIMETHYLCYCLOHEXYL)3OXO23DIHYDRO1HISOINDOL1YL)AMINO)3(2ETHYLPHENYL)PROPANOATE
MFCD09960073
STK079657
ZINC000013892882
ZINC000245253963
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